SCHEMBL19377456

SCHEMBL19377456

C[C@H](NC(=O)Nc1ccc(S(=O)(=O)Cc2ccc(CO)cc2)cc1)c1cccc(Cl)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 3/20 0.40
▸ ITGB1 P05556 2/20 0.39
▸ ITGA4 P13612 2/20 0.39
▸ FAAH O00519 2/20 0.39
▸ MGLL Q99685 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CA12 O43570 3/20 0.38
▸ CA1 P00915 3/20 0.38
▸ CA2 P00918 3/20 0.38
▸ CA9 Q16790 3/20 0.38
▸ GRM4 Q14833 2/20 0.38
▸ PCTP Q9UKL6 1/20 0.38
▸ STARD10 Q9Y365 1/20 0.38
▸ IDH1 O75874 1/20 0.37
▸ RORC P51449 1/20 0.37
▸ GHSR Q92847 2/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ AOC2 O75106 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19377454 1.00 NAMPT (0.40) NAMPTITGB1ITGA4FAAHMGLL
SCHEMBL19377419 0.93 KLKB1 (0.41) NAMPTITGB1ITGA4FAAHMGLL
SCHEMBL19377420 0.93 KLKB1 (0.41) NAMPTITGB1ITGA4FAAHMGLL
SCHEMBL19377131 0.92 NAMPT (0.39) NAMPTITGB1ITGA4FAAHMGLL
SCHEMBL19377133 0.92 NAMPT (0.39) NAMPTITGB1ITGA4FAAHMGLL
SCHEMBL19377517 0.92 KMT2A (0.41) NAMPTITGB1ITGA4LMNAPCTP
SCHEMBL19377399 0.92 SCN3A (0.44) NAMPTITGB1ITGA4FAAHMGLL
SCHEMBL19377515 0.92 KMT2A (0.41) NAMPTITGB1ITGA4LMNAPCTP
SCHEMBL19377400 0.92 SCN3A (0.44) NAMPTITGB1ITGA4FAAHMGLL
SCHEMBL19377373 0.90 TSHR (0.46) NAMPTITGB1ITGA4FAAHMGLL

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US claimed
EP-3390355-B1 BENZENESULFONYL-ASYMMETRIC UREAS AND MEDICAL USES THEREOF HELSINN HEALTHCARE SA (CH) 2022-12-28 — — EP disclosed
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US disclosed
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US disclosed
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof HELSINN HEALTHCARE SA (CH) 2017-09-28 — — US disclosed
WO-2017162390-A1 BENZENESULFONYL-ASYMMETRIC UREAS AND MEDICAL USES THEREOF HELSINN HEALTHCARE SA (CH) 2017-09-28 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170275301-A1 Benzenesulfonyl-Asymmetric Ureas and Medical Uses Thereof UTS2R, GHSR, GRPR NAMPT 3742/4885ITGB1 4488/4885ITGA4 4733/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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